Geometry & MOs

Info

ID:	350234
PubChem CID:	127277312
Reduced:	SO2N5C19H31 (1)
Stoich.:	AB2C5D19E31 (1)
Weight, g/mol:	355.200825
ΔH_f, kcal/mol:	-80.4
Dipole, Da:	1.91
IP(EA), eV:	-8.89(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methylcyclopropyl)-4-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=CSC(=N1)C(C)NC(=O)N2CCN(CC2)CC(=O)N3CCCCCC3

DOS

IR

Vibrations